SCHEMBL181641

SCHEMBL181641

CNC(=N)N

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Ethane SCHEMBL27569889 0.96
Methane SCHEMBL28838006 0.96
Guanidine SCHEMBL4428313 0.96
Hydrochloric Acid SCHEMBL439854 0.96
Bromide SCHEMBL11505134 0.96
SCHEMBL28868195 0.96
Water SCHEMBL1971738 0.96
SCHEMBL29183240 0.96
Hydrochloric Acid SCHEMBL27469418 0.96
Iodide SCHEMBL9536874 0.96

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Appears in 6218 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4747627-A1 METHODS AND SYSTEMS FOR PREDICTIVE CLASSIFICATION BY MASS SPECTROMETRY AND TRAINED LARGE SPECTRAL MODELS Matterworks Inc (US) 2026-05-27 EP claimed
US-12624262-B2 High modulus, toughened one-component epoxy structural adhesives with high aspect ratio fillers DDP SPECIALTY ELECTRONIC MATERIALS US, LLC (US) 2026-05-12 US claimed
US-12584924-B2 Compositions and methods for diagnosing and treating chronic kidney disease SOCIETE DES PRODUITS NESTLE S.A. (CH) 2026-03-24 US claimed
US-12534587-B2 Thermally expandable compositions comprising a chemical blowing agent SIKA TECHNOLOGY AG (CH) 2026-01-27 US claimed
US-20250389737-A1 FACTOR Xa REAGENT INSTR LABORATORY CO (US) 2025-12-25 US claimed
EP-4667582-A1 FACTOR XA REAGENT Instrumentation Laboratory Company (US) 2025-12-24 EP claimed
EP-4587176-A2 POLYGUANIDINE-CONTAINING MEMBRANES AND METHODS OF USING THEREOF Ohio State Innovation Foundation (US) 2025-07-23 EP claimed
US-12352695-B2 System and method for monitoring the health of dialysis patients VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2025-07-08 US claimed
WO-2025133394-A1 METABOLIC FINGERPRINTING OF SALIVA SAMPLES USING NMR MAVEN HEALTH GMBH (CH) 2025-06-26 WO claimed
US-20250198986-A1 NOVEL BIOMARKERS FOR DIAGNOSING A MAJOR DEPRESSIVE IN EXHALED BREATH OTTO-VON-GUERICKE-UNIVERSITAT MAGDEBURG (DE) 2025-06-19 US claimed
EP-0001699-B1 DERIVATIVES OF FURYL COMPOUNDS, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLAXO GROUP LIMITED (GB) 1982-02-24 EP claimed
EP-0039903-A2 8-Substituted pyrrolizidines and quaternary ammonium salts thereof SUNTORY KABUSHIKI KAISHA (JP) 1981-11-18 EP claimed
EP-0035616-A1 Production of immunoglobulin having a high monomer content Juridical Foundation The Chemo-Sero-Therapeutic Research Institute (JP) 1981-09-16 EP claimed
US-4247632-A QUANTITATIVE ANALYSIS OF METHYLAMINE AND UREA PRODUCTS; CULTURES USING ALCALIGENES KIKKOMAN SHOYU CO., LTD. (JP) 1981-01-27 US claimed
US-4149851-A Concentrated aqueous dye compositions containing a low molecular weight amide FIDELITY UNION TRUST COMPANY, EXECUTIVE TRUSTEE UNDER SANDOZ TRUST (US) 1979-04-17 US claimed
US-4143039-A ANTIBACTERIAL 3-(5-TETRAZOLYL)PENAM COMPOUNDS PFIZER INC. (US) 1979-03-06 US claimed
US-4115385-A PENICILLINS PFIZER INC. (US) 1978-09-19 US claimed
US-4113282-A TETRANITRODIPHENYL ACETIC ACID DERIVATIVES THE MEAD CORPORATION (US) 1978-09-12 US claimed
US-4032521-A ANTIBIOTICS MERCK & CO., INC. (US) 1977-06-28 US claimed
US-3979384-A ANTIBIOTICS MERCK & CO., INC. (US) 1976-09-07 US claimed